methyl 5-[[2-(4-ethylpiperazin-1-yl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[2-(4-ethylpiperazin-1-yl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[2-(4-ethylpiperazin-1-yl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[2-(4-ethyl-1-piperazinyl)anilino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(4-ethylpiperazin-1-yl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[2-(4-ethylpiperazino)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C21H28N4O3/c1-5-24-10-12-25(13-11-24)17-9-7-6-8-16(17)23-20(26)19-14(2)18(15(3)22-19)21(27)28-4/h6-9,22H,5,10-13H2,1-4H3,(H,23,26)